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Methanesulfonic acid (R)-2-tert-butoxycarbonylamino-butyl ester

HCID 11173183
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
474645-98-2
Standard SMILES
CC[C@H](COS(C)(=O)=O)NC(=O)OC(C)(C)C
InChIKey
KJZHEULQLNAULU-MRVPVSSYSA-N
Molecular formula
C10H21NO5S
Average molar mass
267.34 g/mol
Monoisotopic mass
267.11404394

Names & identifiers

Preferred name
Methanesulfonic acid (R)-2-tert-butoxycarbonylamino-butyl ester
IUPAC
[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butyl] methanesulfonate
English name
N-tert-Butoxycarbonyl (R)-2-Aminobutan-1-ol Methanesulfonic Acid
Molecular formula
C10H21NO5S
Molecular weight
267.34

Names & synonyms

474645-98-2Methanesulfonic acid (R)-2-tert-butoxycarbonylamino-butyl esterN-tert-Butoxycarbonyl (R)-2-Aminobutan-1-ol Methanesulfonic Acid[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butyl] methanesulfonateKJZHEULQLNAULU-MRVPVSSYSA-N(R)-2-(Boc-amino)butyl MethanesulfonateSCHEMBL8230634DTXSID30457700SY477950(2R)-2-[(tert-Butoxycarbonyl)amino]butyl methanesulfonateN-[(1R)-1-[[(Methylsulfonyl)oxy]Methyl]propyl]carbaMic AciN-tert-Butoxycarbonyl (R)-2-Aminobutan-1-ol Methanesulfonate
Show more names
Methanesulfonic Acid (R)-2-tert-ButoxycarbonylaMinobutyl EsterMethanesulfonic Acid (R)-2-[(tert-Butoxycarbonyl)aMino]butyl EsterCarbamic acid, N-[(1R)-1-[[(methylsulfonyl)oxy]methyl]propyl]-, 1,1-dimethylethyl ester

Database identifiers

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
90.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
17
Formal charge
0
Complexity
339

Physicochemical properties

solubility
Chloroform, Dimethylformamide, DMSO
form
Solid
color
White

Chemistry & industry

Applications

UsesTorcetrapib intermediate.

Suppliers4 total

安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
CAS
474645-98-2
PubChem CID
11173183
DTXSID
DTXSID30457700